5-(3-phenylmethoxyphenyl)-7-(4-pyrrolidin-1-ylcyclohexyl)pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(3-phenylmethoxyphenyl)-7-(4-pyrrolidin-1-ylcyclohexyl)pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 5-(3-benzyloxyphenyl)-7-(4-pyrrolidin-1-ylcyclohexyl)pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 5-(3-phenylmethoxyphenyl)-7-[4-(1-pyrrolidinyl)cyclohexyl]-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 5-(3-phenylmethoxyphenyl)-7-(4-pyrrolidin-1-ylcyclohexyl)pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [5-(3-benzoxyphenyl)-7-(4-pyrrolidinocyclohexyl)pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C29H33N5O MolecularWeight: 467.60522

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2CCC(CC2)N3C=C(C4=C3N=CN=C4N)C5=CC(=CC=C5)OCC6=CC=CC=C6

Isomeric SMILES

C1CCN(C1)C2CCC(CC2)N3C=C(C4=C3N=CN=C4N)C5=CC(=CC=C5)OCC6=CC=CC=C6

InChI

InChI=1S/C29H33N5O/c30-28-27-26(22-9-6-10-25(17-22)35-19-21-7-2-1-3-8-21)18-34(29(27)32-20-31-28)24-13-11-23(12-14-24)33-15-4-5-16-33/h1-3,6-10,17-18,20,23-24H,4-5,11-16,19H2,(H2,30,31,32)